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Home > Nitro Compounds > 218144-79-7
218144-79-7 | 3-(3-Nitrophenyl)-5-(thiophen-2-yl)-1,2,4-oxadiazole
CAS No: 218144-79-7 Catalog No: AG003I2I MDL No:MFCD00116234
Product Description
Catalog Number:
AG003I2I
Chemical Name:
3-(3-Nitrophenyl)-5-(thiophen-2-yl)-1,2,4-oxadiazole
CAS Number:
218144-79-7
Molecular Formula:
C12H7N3O3S
Molecular Weight:
273.2673
MDL Number:
MFCD00116234
IUPAC Name:
3-(3-nitrophenyl)-5-thiophen-2-yl-1,2,4-oxadiazole
InChI:
InChI=1S/C12H7N3O3S/c16-15(17)9-4-1-3-8(7-9)11-13-12(18-14-11)10-5-2-6-19-10/h1-7H
InChI Key:
SQURSOAJNRVVBR-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)c1noc(n1)c1cccs1
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.021g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.266g/mol
Monoisotopic Mass:
273.021g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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